1-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]benzotriazole

Systemtic Name: 1-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]benzotriazole Openeye Name: 1-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]benzotriazole CAS Name: 1-[6-(3,5-dimethyl-1-pyrazolyl)-5-nitro-4-pyrimidinyl]benzotriazole IUPAC Name: 1-[6-(3,5-dimethylpyrazol-1-yl)-5-nitropyrimidin-4-yl]benzotriazole Traditional Name: 1-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]benzotriazole Formula: C15H12N8O2 MolecularWeight: 336.30818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3)C

Isomeric SMILES

CC1=CC(=NN1C2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3)C

InChI

InChI=1S/C15H12N8O2/c1-9-7-10(2)21(19-9)14-13(23(24)25)15(17-8-16-14)22-12-6-4-3-5-11(12)18-20-22/h3-8H,1-2H3